input word = C00032458

Metabolite InformationStructural formula
Name Upunaphenol N
(-)-Upunaphenol N
Formula C57H42O13
Mw 934.26254143
CAS RN 960607-77-6
C_ID C00032458 ,
InChIKey LBMWNAQULPMCGJ-KUFAAHFXNA-N
InChICode InChI=1S/C57H42O13/c58-24-40-54(68)52-48(39-21-37(66)23-42-47(39)45(29-17-34(63)19-35(64)18-29)55(69-42)27-5-13-32(61)14-6-27)44(26-3-11-31(60)12-4-26)50-43(25-1-9-30(59)10-2-25)46-38(20-36(65)22-41(46)67)49-53(51(50)52)57(40)70-56(49)28-7-15-33(62)16-8-28/h1-24,43-45,48-50,55-56,59-68H/t43-,44+,45+,48-,49-,50+,55-,56+/m0/s1
SMILES c12c(c(cc(c1)O)[C@@H]1c3c(c(c4c5c3[C@H]([C@H](c3c([C@@H]5[C@H](O4)c4ccc(cc4)O)cc(cc3O)O)c3ccc(cc3)O)[C@@H]1c1ccc(cc1)O)C=O)O)[C@H]([C@@H](O2)c1ccc(cc1)O)c1cc(cc(c1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipterocarpaceaeUpuna borneensis Ref.
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